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1,2,5-Oxadiazol-3-amine, 4-[5-(3-chloro-2-benzothienyl)-1,2,4-oxadiazol-3-yl]-
SpectraBase Compound ID DAVQTi0OsJ5
InChI InChI=1S/C12H6ClN5O2S/c13-7-5-3-1-2-4-6(5)21-9(7)12-15-11(18-19-12)8-10(14)17-20-16-8/h1-4H,(H2,14,17)
InChIKey XDZMTQJCBFIQLY-UHFFFAOYSA-N
Mol Weight 319.73 g/mol
Molecular Formula C12H6ClN5O2S
Exact Mass 318.993073 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IRoxwT0gbfX
Name 1,2,5-Oxadiazol-3-amine, 4-[5-(3-chloro-2-benzothienyl)-1,2,4-oxadiazol-3-yl]-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H6ClN5O2S
InChI InChI=1S/C12H6ClN5O2S/c13-7-5-3-1-2-4-6(5)21-9(7)12-15-11(18-19-12)8-10(14)17-20-16-8/h1-4H,(H2,14,17)
InChIKey XDZMTQJCBFIQLY-UHFFFAOYSA-N
Molecular Weight 319.726 g/mol
SMILES Nc1c(-c2nc(-c3sc4ccccc4c3Cl)on2)non1
SPLASH splash10-0292-2931000000-1456ccf9c8048d6466ef
Synonyms 4-[5-(3-chloranyl-1-benzothiophen-2-yl)-1,2,4-oxadiazol-3-yl]-1,2,5-oxadiazol-3-amine 4-[5-(3-Chloro-1-benzothien-2-yl)-1,2,4-oxadiazol-3-yl]-1,2,5-oxadiazol-3-ylamine 4-[5-(3-chloro-1-benzothiophen-2-yl)-1,2,4-oxadiazol-3-yl]-1,2,5-oxadiazol-3-amine 4-[5-(3-chlorobenzothiophen-2-yl)-1,2,4-oxadiazol-3-yl]-1,2,5-oxadiazol-3-amine [4-[5-(3-chlorobenzothiophen-2-yl)-1,2,4-oxadiazol-3-yl]furazan-3-yl]amine
Wiley ID 1455910